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Methylthiocyclobutendione
SpectraBase Compound ID 1KosP7V84TV
InChI InChI=1S/C5H4O2S/c1-8-4-2-3(6)5(4)7/h2H,1H3
InChIKey MQZVXKDRAPOEPX-UHFFFAOYSA-N
Mol Weight 128.14 g/mol
Molecular Formula C5H4O2S
Exact Mass 127.993201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsoBflu8Q8K
Name Methylthiocyclobutendione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H4O2S
InChI InChI=1S/C5H4O2S/c1-8-4-2-3(6)5(4)7/h2H,1H3
InChIKey MQZVXKDRAPOEPX-UHFFFAOYSA-N
Molecular Weight 128.145 g/mol
SMILES C1(=CC(C1=O)=O)SC
SPLASH splash10-0udi-0900000000-e670247540b7ed464e63
Source of Spectrum SO-1979-364-13
Synonyms 3-Methylthio-3-cyclobuten-1,2-dione 3-(methylsulfanyl)-3-cyclobutene-1,2-dione
Wiley ID 1537241